Search        

Current filters:
Add filters:

Use filters to refine the search results.

Item hits:
PreviewIssue DateTitleAuthor(s)ProgramCalculation typeMethod(s)Basis SetEnergySolv.Vibr.Orb.
thumbnail.jpeg1-Jul-2019/dispersion/Ru_9/Eooh dispersion_Ru-9-OOH-freqCraig, MichaelGaussian; 09; EM64L-G09RevA.02Single point StructureUTPSShLANL2DZ 6-31G(D) 6-31G(D,P) 6-31+G(D) GEN-2059.3508641; Eh
thumbnail.jpeg1-Jul-2019/dispersion/Ru_5/Evac dispersion_Ru-5-VAC-freq-dispCraig, MichaelGaussian; 09; EM64L-G09RevA.02Single point StructureUTPSShLANL2DZ 6-31G(D) 6-31G(D,P) 6-31+G(D) GEN-1542.8171285; Eh
thumbnail.jpeg1-Jul-2019/dispersion/Ru_3/Eooh dispersion_Ru-3-OOH-dispCraig, MichaelGaussian; 09; EM64L-G09RevA.02Single point StructureUTPSShLANL2DZ 6-31G(D) 6-31G(D,P) 6-31+G(D) GEN-1691.7552533; Eh
thumbnail.jpeg1-Jul-2019/dispersion/Ru_3/Eo4 dispersion_Ru-3-O4-dispf-dispCraig, MichaelGaussian; 09; EM64L-G09RevA.02Single point StructureUTPSShLANL2DZ 6-31G(D) 6-31G(D,P) 6-31+G(D) GEN-1615.9618439; Eh
thumbnail.jpeg1-Jul-2019/dispersion/Co_16/Eooh dispersion_Co-16-OOH-freqCraig, MichaelGaussian; 09; EM64L-G09RevA.02Single point StructureUTPSShLANL2DZ 6-31G(D) 6-31G(D,P) 6-31+G(D) GEN-1840.3922582; Eh
thumbnail.jpeg1-Jul-2019/dispersion/Mn_11/Eo dispersion_Mn-11-OCraig, MichaelGaussian; 09; EM64L-G09RevA.02Single point StructureUTPSShLANL2DZ 6-31G(D) 6-31G(D,P) 6-31+G(D) GEN-1302.2306261; Eh
thumbnail.jpeg1-Jul-2019/dispersion/Mn_10/Eooh dispersion_Mn-10-OOH-freqCraig, MichaelGaussian; 09; EM64L-G09RevA.02Single point StructureUTPSShLANL2DZ 6-31G(D) 6-31G(D,P) 6-31+G(D) GEN-1417.7673464; Eh
thumbnail.jpeg1-Jul-2019/dispersion/Mn_10/Evac dispersion_Mn-10-VAC-freqCraig, MichaelGaussian; 09; EM64L-G09RevA.02Single point StructureUTPSShLANL2DZ 6-31G(D) 6-31G(D,P) 6-31+G(D) GEN-1266.8104597; Eh
thumbnail.jpeg1-Jul-2019/dispersion/Ru_7/Eoh dispersion_Ru-7-OH-freqCraig, MichaelGaussian; 09; EM64L-G09RevA.02Single point StructureUTPSShLANL2DZ 6-31G(D) 6-31G(D,P) 6-31+G(D) GEN-1785.0827482; Eh
thumbnail.jpeg1-Jul-2019/dispersion/Ru_4/Eo dispersion_Ru-4-OCraig, MichaelGaussian; 09; EM64L-G09RevA.02Single point StructureUTPSShLANL2DZ 6-31G(D) 6-31G(D,P) 6-31+G(D) GEN-1504.606245; Eh
Results 51-60 of 77 (Search time: 0.001 seconds).

Discover